DeepMet

Record Information
HMDB Status	Not Available
Creation Date	2024-02-21 14:37:24 UTC
Update Date	2025-03-25 00:45:31 UTC
HMDB ID	Not Available
Metabolite Identification
DeepMet ID	DMID02149705
Frequency	0.5
Structure
Chemical Formula	C₁₀H₁₉N₅O₃
Molecular Mass	257.1488
SMILES	N=C(N)NCCCC(NC(=O)C1(N)CC1)C(=O)O
InChI Key	UXQPAYWWVWASTD-UHFFFAOYSA-N
Chemical Taxonomy
Kingdom	organic compounds
Superclass	organic acids and derivatives
Class	carboxylic acids and derivatives
Subclass	amino acids, peptides, and analogues
Direct Parent	dipeptides
Geometric Descriptor	aliphatic homomonocyclic compounds
Alternative Parents	alpha amino acids arginine and derivatives carbocyclic fatty acids carbonyl compounds carboximidamides carboxylic acids cyclopropanecarboxylic acids and derivatives guanidines hydrocarbon derivatives imines monoalkylamines monocarboxylic acids and derivatives n-acyl-alpha amino acids organic oxides organopnictogen compounds secondary carboxylic acid amides
Substituents	fatty acyl carbocyclic fatty acid carbonyl group carboxylic acid guanidine imine cyclopropanecarboxylic acid or derivatives fatty acid alpha-amino acid or derivatives organic oxide arginine or derivatives organonitrogen compound alpha-amino acid organopnictogen compound n-acyl-alpha amino acid or derivatives n-acyl-alpha-amino acid carboximidamide carboxamide group alpha-dipeptide secondary carboxylic acid amide monocarboxylic acid or derivatives organic oxygen compound aliphatic homomonocyclic compound hydrocarbon derivative primary aliphatic amine organic nitrogen compound organooxygen compound

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